2-methyl-1-[(2-nitrophenyl)amino]-1-(propylamino)butane-1,4-diol

Systemtic Name: 2-methyl-1-[(2-nitrophenyl)amino]-1-(propylamino)butane-1,4-diol Openeye Name: 2-methyl-1-(2-nitroanilino)-1-(propylamino)butane-1,4-diol CAS Name: 2-methyl-1-(2-nitroanilino)-1-(propylamino)butane-1,4-diol IUPAC Name: 2-methyl-1-(2-nitroanilino)-1-(propylamino)butane-1,4-diol Traditional Name: 2-methyl-1-(2-nitroanilino)-1-(propylamino)butane-1,4-diol Formula: C14H23N3O4 MolecularWeight: 297.35012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C(C)CCO)(NC1=CC=CC=C1[N+](=O)[O-])O

Isomeric SMILES

CCCNC(C(C)CCO)(NC1=CC=CC=C1[N+](=O)[O-])O

InChI

InChI=1S/C14H23N3O4/c1-3-9-15-14(19,11(2)8-10-18)16-12-6-4-5-7-13(12)17(20)21/h4-7,11,15-16,18-19H,3,8-10H2,1-2H3